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12-Ketostearic acid sodium

CAT: 0013-GTR19351458-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19351458-01Size:10 mg
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Description
12-Ketostearic acid sodium is a synthetic membrane probe designed to interact with the hydrophobic regions of lipid bilayers. The terminal carboxylic acid group has the ability to form stable amide bonds through reactions with primary amine groups.
CAS Number
73536-57-9
Molecular Weight
321.451
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Sodium 12-oxooctadecanoate
CAS Number73536-57-9
PubChem CID46782032
IUPAC Namesodium 12-oxooctadecanoate
Molecular FormulaC18H33NaO3
Molecular Weight320.4
Topological Polar Surface Area57.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Heavy Atom Count22
Formal Charge0
Complexity267
SMILES
CCCCCCC(=O)CCCCCCCCCCC(=O)[O-].[Na+]
InChI
InChI=1S/C18H34O3.Na/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h2-16H2,1H3,(H,20,21);/q;+1/p-1
InChIKey
MNBVTXHXLAVTST-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium 12-oxooctadecanoate
CAS: 73536-57-9
CID: 46782032
Formula: C18H33NaO3
MW: 320.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight320.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Exact Mass320.23273919
Monoisotopic Mass320.23273919
Topological Polar Surface Area57.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity267
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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